BDBM215742 US9296748, II-29

SMILES: C[C@@H](c1ccccn1)n1c(nc2cnc(cc12)N1CCOC[C@@H]1C)-c1cc(C)c(=O)n(C)c1

InChI Key: InChIKey=HWPWCHLWEOWCII-ROUUACIJSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 215742   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Bromodomain-containing protein 4 (BRD4) (aa 44-168) (Homo sapiens (Human))	BDBM215742 (US9296748, II-29) Show SMILES C[C@@H](c1ccccn1)n1c(nc2cnc(cc12)N1CCOC[C@@H]1C)-c1cc(C)c(=O)n(C)c1 |r| Show InChI InChI=1S/C25H28N6O2/c1-16-11-19(14-29(4)25(16)32)24-28-21-13-27-23(30-9-10-33-15-17(30)2)12-22(21)31(24)18(3)20-7-5-6-8-26-20/h5-8,11-14,17-18H,9-10,15H2,1-4H3/t17-,18-/m0/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description Compounds are diluted in serial dilution 1:5 in assay buffer from 10 mM stock in DMSO (100 μM start concentration) in white OptiPlate-384 (Perki...				US Patent US9296748 (2016) BindingDB Entry DOI: 10.7270/Q21G0K4K
					More data for this Ligand-Target Pair